Cas no 5605-11-8 (BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL-)
![BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL- structure](https://ossimg.kuujia.com/scimg/6000/5605-11-8x500.png)
5605-11-8 structure
Product Name:BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL-
CAS No:5605-11-8
MF:C12H20O2
MW:196.286004066467
CID:3408935
PubChem ID:754758
Update Time:2025-04-21
BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL- Chemical and Physical Properties
Names and Identifiers
-
- BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL-
- 4-propylbicyclo[2.2.2]octane-1-carboxylic acid
- Oprea1_512142
- SCHEMBL20169930
- SCHEMBL20162490
- AKOS000618541
- HMS1677K04
- WAY-301288
- AA-516/30131050
- SCHEMBL3375229
- 5605-11-8
- SCHEMBL20625753
- Oprea1_442940
-
- Inchi： 1S/C12H20O2/c1-2-3-11-4-7-12(8-5-11,9-6-11)10(13)14/h2-9H2,1H3,(H,13,14)
- InChI Key： SMKDVIZYHSWNMF-UHFFFAOYSA-N
- SMILES： C12(CCC(CC1)(CC2)CCC)C(O)=O
Computed Properties
- Exact Mass: 196.146329876Da
- Monoisotopic Mass: 196.146329876Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 220
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 37.3?2
BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID, 4-PROPYL- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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